{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.35419 0 0 ] "si-unit" "m" "si-value" [ 5.35419e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.128546 5.3923 0 ] "si-unit" "m" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0752915 -0.0875116 5.49588 ] "si-unit" "m" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00225511 0.0160353 -0.067451 ] [ 1.37153 1.32836 1.3623 ] [ 0.0305896 2.71279 2.89841 ] [ 1.38735 4.02786 4.05412 ] [ 2.7178 -0.0621827 2.7228 ] [ 3.99586 1.31169 4.14487 ] [ 2.78113 2.65016 0.11239 ] [ 4.13075 3.95144 1.3393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.25511e-13 1.60353e-12 -6.7451e-12 ] [ 1.37153e-10 1.32836e-10 1.3623e-10 ] [ 3.05896e-12 2.71279e-10 2.89841e-10 ] [ 1.38735e-10 4.027860000000001e-10 4.05412e-10 ] [ 2.7178e-10 -6.21827e-12 2.7228e-10 ] [ 3.99586e-10 1.31169e-10 4.14487e-10 ] [ 2.78113e-10 2.65016e-10 1.1239e-11 ] [ 4.13075e-10 3.95144e-10 1.3393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.15169139999999995 0.2088610999999999 0.5124129999999998 ] [ -0.3952790999999999 -0.013153999999999996 0.15284749999999994 ] [ 0.03173359999999999 -0.3973689999999999 -0.23311489999999993 ] [ 0.7918436999999998 -0.2381960999999999 0.13408059999999994 ] [ 0.011012999999999997 0.025927199999999994 0.042034099999999984 ] [ -0.04315529999999999 -0.2951210999999999 -0.3227725999999999 ] [ -0.6168817999999998 0.4213572999999998 -0.13538399999999995 ] [ 0.3724172999999999 0.2876945999999999 -0.15010379999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.43036414656421e-10 3.346323714145707e-10 8.2097612879399e-10 ] [ -6.333069327108651e-10 -2.107503127000319e-11 2.448886910477279e-10 ] [ 5.084283201381886e-11 -6.36655321630675e-10 -3.734912427401298e-10 ] [ 1.268673463467769e-09 -3.816322225857387e-10 2.148208026228364e-10 ] [ 1.764477112487039e-11 4.153995368280575e-11 6.734605229636925e-11 ] [ -6.914241272361022e-11 -4.728361267247787e-10 -5.1713871355483e-10 ] [ -9.88353597757021e-10 6.750888150634115e-10 -2.169090796303871e-10 ] [ 5.966782912414596e-10 4.609375620504075e-10 -2.40492799053239e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 153.01378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.451551009762346e-17 } }